3-(6-chloranyl-2-oxidanylidene-1,4-benzoxazin-3-yl)-N-[2-[(4-nitrophenyl)amino]ethyl]propanamide

Systemtic Name: 3-(6-chloranyl-2-oxidanylidene-1,4-benzoxazin-3-yl)-N-[2-[(4-nitrophenyl)amino]ethyl]propanamide Openeye Name: 3-(6-chloro-2-oxo-1,4-benzoxazin-3-yl)-N-[2-(4-nitroanilino)ethyl]propanamide CAS Name: 3-(6-chloro-2-oxo-1,4-benzoxazin-3-yl)-N-[2-(4-nitroanilino)ethyl]propanamide IUPAC Name: 3-(6-chloro-2-oxo-1,4-benzoxazin-3-yl)-N-[2-(4-nitroanilino)ethyl]propanamide Traditional Name: 3-(6-chloro-2-keto-1,4-benzoxazin-3-yl)-N-[2-(4-nitroanilino)ethyl]propionamide Formula: C19H17ClN4O5 MolecularWeight: 416.81508

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NCCNC(=O)CCC2=NC3=C(C=CC(=C3)Cl)OC2=O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NCCNC(=O)CCC2=NC3=C(C=CC(=C3)Cl)OC2=O)[N+](=O)[O-]

InChI

InChI=1S/C19H17ClN4O5/c20-12-1-7-17-16(11-12)23-15(19(26)29-17)6-8-18(25)22-10-9-21-13-2-4-14(5-3-13)24(27)28/h1-5,7,11,21H,6,8-10H2,(H,22,25)