(2R)-N-propyl-4-(3-pyrrol-1-ylphenyl)carbonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: (2R)-N-propyl-4-(3-pyrrol-1-ylphenyl)carbonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: (2R)-N-propyl-4-(3-pyrrol-1-ylbenzoyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: (2R)-4-[oxo-[3-(1-pyrrolyl)phenyl]methyl]-N-propyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: (2R)-N-propyl-4-(3-pyrrol-1-ylbenzoyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: (2R)-N-propyl-4-(3-pyrrol-1-ylbenzoyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C23H23N3O3 MolecularWeight: 389.44702

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1CN(C2=CC=CC=C2O1)C(=O)C3=CC(=CC=C3)N4C=CC=C4

Isomeric SMILES

CCCNC(=O)[C@H]1CN(C2=CC=CC=C2O1)C(=O)C3=CC(=CC=C3)N4C=CC=C4

InChI

InChI=1S/C23H23N3O3/c1-2-12-24-22(27)21-16-26(19-10-3-4-11-20(19)29-21)23(28)17-8-7-9-18(15-17)25-13-5-6-14-25/h3-11,13-15,21H,2,12,16H2,1H3,(H,24,27)/t21-/m1/s1