4-[2-[4-(3-methylphenyl)piperazin-1-yl]ethanoyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: 4-[2-[4-(3-methylphenyl)piperazin-1-yl]ethanoyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: 4-[2-[4-(m-tolyl)piperazin-1-yl]acetyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: 4-[2-[4-(3-methylphenyl)-1-piperazinyl]-1-oxoethyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: 4-[2-[4-(3-methylphenyl)piperazin-1-yl]acetyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: 4-[2-[4-(m-tolyl)piperazino]acetyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C22H26N4O3 MolecularWeight: 394.46684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)CC(=O)N3CC(OC4=CC=CC=C43)C(=O)N

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)CC(=O)N3CC(OC4=CC=CC=C43)C(=O)N

InChI

InChI=1S/C22H26N4O3/c1-16-5-4-6-17(13-16)25-11-9-24(10-12-25)15-21(27)26-14-20(22(23)28)29-19-8-3-2-7-18(19)26/h2-8,13,20H,9-12,14-15H2,1H3,(H2,23,28)