N-[2-(4-aminophenyl)ethyl]-3-nitro-4-[4-(2-oxidanylidene-4H-3,1-benzoxazin-1-yl)piperidin-1-yl]benzamide

Systemtic Name: N-[2-(4-aminophenyl)ethyl]-3-nitro-4-[4-(2-oxidanylidene-4H-3,1-benzoxazin-1-yl)piperidin-1-yl]benzamide Openeye Name: N-[2-(4-aminophenyl)ethyl]-3-nitro-4-[4-(2-oxo-4H-3,1-benzoxazin-1-yl)-1-piperidyl]benzamide CAS Name: N-[2-(4-aminophenyl)ethyl]-3-nitro-4-[4-(2-oxo-4H-3,1-benzoxazin-1-yl)-1-piperidinyl]benzamide IUPAC Name: N-[2-(4-aminophenyl)ethyl]-3-nitro-4-[4-(2-oxo-4H-3,1-benzoxazin-1-yl)piperidin-1-yl]benzamide Traditional Name: N-[2-(4-aminophenyl)ethyl]-4-[4-(2-keto-4H-3,1-benzoxazin-1-yl)piperidino]-3-nitro-benzamide Formula: C28H29N5O5 MolecularWeight: 515.56036

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C3=CC=CC=C3COC2=O)C4=C(C=C(C=C4)C(=O)NCCC5=CC=C(C=C5)N)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1N2C3=CC=CC=C3COC2=O)C4=C(C=C(C=C4)C(=O)NCCC5=CC=C(C=C5)N)[N+](=O)[O-]

InChI

InChI=1S/C28H29N5O5/c29-22-8-5-19(6-9-22)11-14-30-27(34)20-7-10-25(26(17-20)33(36)37)31-15-12-23(13-16-31)32-24-4-2-1-3-21(24)18-38-28(32)35/h1-10,17,23H,11-16,18,29H2,(H,30,34)