N-(2-diethylaminoethyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-(pentanoylamino)benzamide

Systemtic Name: N-(2-diethylaminoethyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-(pentanoylamino)benzamide Openeye Name: N-(2-diethylaminoethyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-(pentanoylamino)benzamide CAS Name: N-(2-diethylaminoethyl)-2-[4-(2-methoxyphenyl)-1-piperazinyl]-5-(1-oxopentylamino)benzamide IUPAC Name: N-(2-diethylaminoethyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-(pentanoylamino)benzamide Traditional Name: N-(2-diethylaminoethyl)-2-[4-(2-methoxyphenyl)piperazino]-5-(valerylamino)benzamide Formula: C29H43N5O3 MolecularWeight: 509.68342

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=CC(=C(C=C1)N2CCN(CC2)C3=CC=CC=C3OC)C(=O)NCCN(CC)CC

Isomeric SMILES

CCCCC(=O)NC1=CC(=C(C=C1)N2CCN(CC2)C3=CC=CC=C3OC)C(=O)NCCN(CC)CC

InChI

InChI=1S/C29H43N5O3/c1-5-8-13-28(35)31-23-14-15-25(24(22-23)29(36)30-16-17-32(6-2)7-3)33-18-20-34(21-19-33)26-11-9-10-12-27(26)37-4/h9-12,14-15,22H,5-8,13,16-21H2,1-4H3,(H,30,36)(H,31,35)