3-[[4-[(2-methylphenyl)methyl]-1,4-diazepan-1-yl]carbonyl]chromen-2-one

Systemtic Name: 3-[[4-[(2-methylphenyl)methyl]-1,4-diazepan-1-yl]carbonyl]chromen-2-one Openeye Name: 3-[4-(o-tolylmethyl)-1,4-diazepane-1-carbonyl]chromen-2-one CAS Name: 3-[[4-[(2-methylphenyl)methyl]-1,4-diazepan-1-yl]-oxomethyl]-1-benzopyran-2-one IUPAC Name: 3-[4-[(2-methylphenyl)methyl]-1,4-diazepane-1-carbonyl]chromen-2-one Traditional Name: 3-[4-(2-methylbenzyl)-1,4-diazepane-1-carbonyl]coumarin Formula: C23H24N2O3 MolecularWeight: 376.44826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CCCN(CC2)C(=O)C3=CC4=CC=CC=C4OC3=O

Isomeric SMILES

CC1=CC=CC=C1CN2CCCN(CC2)C(=O)C3=CC4=CC=CC=C4OC3=O

InChI

InChI=1S/C23H24N2O3/c1-17-7-2-3-9-19(17)16-24-11-6-12-25(14-13-24)22(26)20-15-18-8-4-5-10-21(18)28-23(20)27/h2-5,7-10,15H,6,11-14,16H2,1H3