7-(3,4-dihydro-2H-quinolin-1-yl)-2-phenyl-6-piperazin-1-yl-2-propan-2-yl-heptanenitrile

Systemtic Name: 7-(3,4-dihydro-2H-quinolin-1-yl)-2-phenyl-6-piperazin-1-yl-2-propan-2-yl-heptanenitrile Openeye Name: 7-(3,4-dihydro-2H-quinolin-1-yl)-2-isopropyl-2-phenyl-6-piperazin-1-yl-heptanenitrile CAS Name: 7-(3,4-dihydro-2H-quinolin-1-yl)-2-phenyl-6-(1-piperazinyl)-2-propan-2-ylheptanenitrile IUPAC Name: 7-(3,4-dihydro-2H-quinolin-1-yl)-2-phenyl-6-piperazin-1-yl-2-propan-2-ylheptanenitrile Traditional Name: 7-(3,4-dihydro-2H-quinolin-1-yl)-2-isopropyl-2-phenyl-6-piperazino-enanthonitrile Formula: C29H40N4 MolecularWeight: 444.6547

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCC(CN1CCCC2=CC=CC=C21)N3CCNCC3)(C#N)C4=CC=CC=C4

Isomeric SMILES

CC(C)C(CCCC(CN1CCCC2=CC=CC=C21)N3CCNCC3)(C#N)C4=CC=CC=C4

InChI

InChI=1S/C29H40N4/c1-24(2)29(23-30,26-12-4-3-5-13-26)16-8-14-27(32-20-17-31-18-21-32)22-33-19-9-11-25-10-6-7-15-28(25)33/h3-7,10,12-13,15,24,27,31H,8-9,11,14,16-22H2,1-2H3