7-methyl-4-[[4-(phenylmethyl)-1,4-diazepan-1-yl]methyl]chromen-2-one

Systemtic Name: 7-methyl-4-[[4-(phenylmethyl)-1,4-diazepan-1-yl]methyl]chromen-2-one Openeye Name: 4-[(4-benzyl-1,4-diazepan-1-yl)methyl]-7-methyl-chromen-2-one CAS Name: 7-methyl-4-[[4-(phenylmethyl)-1,4-diazepan-1-yl]methyl]-1-benzopyran-2-one IUPAC Name: 4-[(4-benzyl-1,4-diazepan-1-yl)methyl]-7-methylchromen-2-one Traditional Name: 4-[(4-benzyl-1,4-diazepan-1-yl)methyl]-7-methyl-coumarin Formula: C23H26N2O2 MolecularWeight: 362.46474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC(=O)O2)CN3CCCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CC(=O)O2)CN3CCCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C23H26N2O2/c1-18-8-9-21-20(15-23(26)27-22(21)14-18)17-25-11-5-10-24(12-13-25)16-19-6-3-2-4-7-19/h2-4,6-9,14-15H,5,10-13,16-17H2,1H3