N-[2-[(3-methoxyphenyl)carbonylamino]ethyl]-4-(4-nitrophenyl)piperazine-1-carboxamide

Systemtic Name: N-[2-[(3-methoxyphenyl)carbonylamino]ethyl]-4-(4-nitrophenyl)piperazine-1-carboxamide Openeye Name: N-[2-[(3-methoxybenzoyl)amino]ethyl]-4-(4-nitrophenyl)piperazine-1-carboxamide CAS Name: N-[2-[[(3-methoxyphenyl)-oxomethyl]amino]ethyl]-4-(4-nitrophenyl)-1-piperazinecarboxamide IUPAC Name: N-[2-[(3-methoxybenzoyl)amino]ethyl]-4-(4-nitrophenyl)piperazine-1-carboxamide Traditional Name: N-[2-(m-anisoylamino)ethyl]-4-(4-nitrophenyl)piperazine-1-carboxamide Formula: C21H25N5O5 MolecularWeight: 427.4537

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)NCCNC(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)NCCNC(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H25N5O5/c1-31-19-4-2-3-16(15-19)20(27)22-9-10-23-21(28)25-13-11-24(12-14-25)17-5-7-18(8-6-17)26(29)30/h2-8,15H,9-14H2,1H3,(H,22,27)(H,23,28)