N-[4-(1,3-benzoxazol-2-yl)phenyl]-3-[(2-nitrophenyl)amino]propanamide

Systemtic Name: N-[4-(1,3-benzoxazol-2-yl)phenyl]-3-[(2-nitrophenyl)amino]propanamide Openeye Name: N-[4-(1,3-benzoxazol-2-yl)phenyl]-3-(2-nitroanilino)propanamide CAS Name: N-[4-(1,3-benzoxazol-2-yl)phenyl]-3-(2-nitroanilino)propanamide IUPAC Name: N-[4-(1,3-benzoxazol-2-yl)phenyl]-3-(2-nitroanilino)propanamide Traditional Name: N-[4-(1,3-benzoxazol-2-yl)phenyl]-3-(2-nitroanilino)propionamide Formula: C22H18N4O4 MolecularWeight: 402.40272

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(O2)C3=CC=C(C=C3)NC(=O)CCNC4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(O2)C3=CC=C(C=C3)NC(=O)CCNC4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C22H18N4O4/c27-21(13-14-23-17-5-1-3-7-19(17)26(28)29)24-16-11-9-15(10-12-16)22-25-18-6-2-4-8-20(18)30-22/h1-12,23H,13-14H2,(H,24,27)