N-[4-[[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]methyl]-2-oxidanylidene-chromen-7-yl]ethanamide

Systemtic Name: N-[4-[[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]methyl]-2-oxidanylidene-chromen-7-yl]ethanamide Openeye Name: N-[2-oxo-4-[[4-(p-tolylmethyl)-1,4-diazepan-1-yl]methyl]chromen-7-yl]acetamide CAS Name: N-[4-[[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]methyl]-2-oxo-1-benzopyran-7-yl]acetamide IUPAC Name: N-[4-[[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]methyl]-2-oxochromen-7-yl]acetamide Traditional Name: N-[2-keto-4-[[4-(4-methylbenzyl)-1,4-diazepan-1-yl]methyl]chromen-7-yl]acetamide Formula: C25H29N3O3 MolecularWeight: 419.51606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCCN(CC2)CC3=CC(=O)OC4=C3C=CC(=C4)NC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)CN2CCCN(CC2)CC3=CC(=O)OC4=C3C=CC(=C4)NC(=O)C

InChI

InChI=1S/C25H29N3O3/c1-18-4-6-20(7-5-18)16-27-10-3-11-28(13-12-27)17-21-14-25(30)31-24-15-22(26-19(2)29)8-9-23(21)24/h4-9,14-15H,3,10-13,16-17H2,1-2H3,(H,26,29)