N-[4-[[4-(quinolin-2-ylmethyl)-1,4-diazepan-1-yl]methyl]phenyl]ethanamide

Systemtic Name: N-[4-[[4-(quinolin-2-ylmethyl)-1,4-diazepan-1-yl]methyl]phenyl]ethanamide Openeye Name: N-[4-[[4-(2-quinolylmethyl)-1,4-diazepan-1-yl]methyl]phenyl]acetamide CAS Name: N-[4-[[4-(2-quinolinylmethyl)-1,4-diazepan-1-yl]methyl]phenyl]acetamide IUPAC Name: N-[4-[[4-(quinolin-2-ylmethyl)-1,4-diazepan-1-yl]methyl]phenyl]acetamide Traditional Name: N-[4-[[4-(2-quinolylmethyl)-1,4-diazepan-1-yl]methyl]phenyl]acetamide Formula: C24H28N4O MolecularWeight: 388.50532

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)CN2CCCN(CC2)CC3=NC4=CC=CC=C4C=C3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)CN2CCCN(CC2)CC3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C24H28N4O/c1-19(29)25-22-10-7-20(8-11-22)17-27-13-4-14-28(16-15-27)18-23-12-9-21-5-2-3-6-24(21)26-23/h2-3,5-12H,4,13-18H2,1H3,(H,25,29)