3-[3-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]-3-oxidanylidene-propyl]-1,3-benzoxazol-2-one

Systemtic Name: 3-[3-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]-3-oxidanylidene-propyl]-1,3-benzoxazol-2-one Openeye Name: 3-[3-oxo-3-[4-(p-tolylmethyl)-1,4-diazepan-1-yl]propyl]-1,3-benzoxazol-2-one CAS Name: 3-[3-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]-3-oxopropyl]-1,3-benzoxazol-2-one IUPAC Name: 3-[3-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]-3-oxopropyl]-1,3-benzoxazol-2-one Traditional Name: 3-[3-keto-3-[4-(4-methylbenzyl)-1,4-diazepan-1-yl]propyl]-1,3-benzoxazol-2-one Formula: C23H27N3O3 MolecularWeight: 393.47878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)CCN3C4=CC=CC=C4OC3=O

Isomeric SMILES

CC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)CCN3C4=CC=CC=C4OC3=O

InChI

InChI=1S/C23H27N3O3/c1-18-7-9-19(10-8-18)17-24-12-4-13-25(16-15-24)22(27)11-14-26-20-5-2-3-6-21(20)29-23(26)28/h2-3,5-10H,4,11-17H2,1H3