3-(2-naphthalen-1-ylethanoylamino)-3-[3-nitro-4-(4-pyridin-2-ylpiperazin-1-yl)phenyl]propanamide

Systemtic Name: 3-(2-naphthalen-1-ylethanoylamino)-3-[3-nitro-4-(4-pyridin-2-ylpiperazin-1-yl)phenyl]propanamide Openeye Name: 3-[[2-(1-naphthyl)acetyl]amino]-3-[3-nitro-4-[4-(2-pyridyl)piperazin-1-yl]phenyl]propanamide CAS Name: 3-[[2-(1-naphthalenyl)-1-oxoethyl]amino]-3-[3-nitro-4-[4-(2-pyridinyl)-1-piperazinyl]phenyl]propanamide IUPAC Name: 3-[(2-naphthalen-1-ylacetyl)amino]-3-[3-nitro-4-(4-pyridin-2-ylpiperazin-1-yl)phenyl]propanamide Traditional Name: 3-[[2-(1-naphthyl)acetyl]amino]-3-[3-nitro-4-[4-(2-pyridyl)piperazino]phenyl]propionamide Formula: C30H30N6O4 MolecularWeight: 538.597

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)C(CC(=O)N)NC(=O)CC3=CC=CC4=CC=CC=C43)[N+](=O)[O-])C5=CC=CC=N5

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)C(CC(=O)N)NC(=O)CC3=CC=CC4=CC=CC=C43)[N+](=O)[O-])C5=CC=CC=N5

InChI

InChI=1S/C30H30N6O4/c31-28(37)20-25(33-30(38)19-22-8-5-7-21-6-1-2-9-24(21)22)23-11-12-26(27(18-23)36(39)40)34-14-16-35(17-15-34)29-10-3-4-13-32-29/h1-13,18,25H,14-17,19-20H2,(H2,31,37)(H,33,38)