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

Systemtic Name: N-(3-nitrophenyl)-4-[2-[(3-nitrophenyl)carbamoylamino]ethyl]piperazine-1-carboxamide Openeye Name: N-(3-nitrophenyl)-4-[2-[(3-nitrophenyl)carbamoylamino]ethyl]piperazine-1-carboxamide CAS Name: 4-[2-[[(3-nitroanilino)-oxomethyl]amino]ethyl]-N-(3-nitrophenyl)-1-piperazinecarboxamide IUPAC Name: N-(3-nitrophenyl)-4-[2-[(3-nitrophenyl)carbamoylamino]ethyl]piperazine-1-carboxamide Traditional Name: N-(3-nitrophenyl)-4-[2-[(3-nitrophenyl)carbamoylamino]ethyl]piperazine-1-carboxamide Formula: C20H23N7O6 MolecularWeight: 457.43992

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCNC(=O)NC2=CC(=CC=C2)[N+](=O)[O-])C(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CCNC(=O)NC2=CC(=CC=C2)[N+](=O)[O-])C(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H23N7O6/c28-19(22-15-3-1-5-17(13-15)26(30)31)21-7-8-24-9-11-25(12-10-24)20(29)23-16-4-2-6-18(14-16)27(32)33/h1-6,13-14H,7-12H2,(H,23,29)(H2,21,22,28)