4-[3-[5-[4-(7-methoxynaphthalen-1-yl)piperazin-1-yl]pentanoylamino]phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid

Systemtic Name: 4-[3-[5-[4-(7-methoxynaphthalen-1-yl)piperazin-1-yl]pentanoylamino]phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid Openeye Name: 4-[3-[5-[4-(7-methoxy-1-naphthyl)piperazin-1-yl]pentanoylamino]phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid CAS Name: 4-[3-[[5-[4-(7-methoxy-1-naphthalenyl)-1-piperazinyl]-1-oxopentyl]amino]phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid IUPAC Name: 4-[3-[5-[4-(7-methoxynaphthalen-1-yl)piperazin-1-yl]pentanoylamino]phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid Traditional Name: 4-[3-[5-[4-(7-methoxy-1-naphthyl)piperazino]pentanoylamino]phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid Formula: C35H40N4O6 MolecularWeight: 612.7153

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)O)C2=CC(=CC=C2)NC(=O)CCCCN3CCN(CC3)C4=CC=CC5=C4C=C(C=C5)OC)C(=O)O

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)O)C2=CC(=CC=C2)NC(=O)CCCCN3CCN(CC3)C4=CC=CC5=C4C=C(C=C5)OC)C(=O)O

InChI

InChI=1S/C35H40N4O6/c1-22-31(34(41)42)33(32(35(43)44)23(2)36-22)25-9-6-10-26(20-25)37-30(40)12-4-5-15-38-16-18-39(19-17-38)29-11-7-8-24-13-14-27(45-3)21-28(24)29/h6-11,13-14,20-21,33,36H,4-5,12,15-19H2,1-3H3,(H,37,40)(H,41,42)(H,43,44)