[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]-[4-(methylamino)-3-nitro-phenyl]methanone

Systemtic Name: [4-(1,3-benzoxazol-2-yl)piperidin-1-yl]-[4-(methylamino)-3-nitro-phenyl]methanone Openeye Name: [4-(1,3-benzoxazol-2-yl)-1-piperidyl]-[4-(methylamino)-3-nitro-phenyl]methanone CAS Name: [4-(1,3-benzoxazol-2-yl)-1-piperidinyl]-[4-(methylamino)-3-nitrophenyl]methanone IUPAC Name: [4-(1,3-benzoxazol-2-yl)piperidin-1-yl]-[4-(methylamino)-3-nitrophenyl]methanone Traditional Name: [4-(1,3-benzoxazol-2-yl)piperidino]-[4-(methylamino)-3-nitro-phenyl]methanone Formula: C20H20N4O4 MolecularWeight: 380.3972

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)C(=O)N2CCC(CC2)C3=NC4=CC=CC=C4O3)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1)C(=O)N2CCC(CC2)C3=NC4=CC=CC=C4O3)[N+](=O)[O-]

InChI

InChI=1S/C20H20N4O4/c1-21-15-7-6-14(12-17(15)24(26)27)20(25)23-10-8-13(9-11-23)19-22-16-4-2-3-5-18(16)28-19/h2-7,12-13,21H,8-11H2,1H3