N-[1-(naphthalen-1-ylmethyl)pyrazol-4-yl]-3-(4-nitropyrazol-1-yl)propanamide

Systemtic Name: N-[1-(naphthalen-1-ylmethyl)pyrazol-4-yl]-3-(4-nitropyrazol-1-yl)propanamide Openeye Name: N-[1-(1-naphthylmethyl)pyrazol-4-yl]-3-(4-nitropyrazol-1-yl)propanamide CAS Name: N-[1-(1-naphthalenylmethyl)-4-pyrazolyl]-3-(4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-[1-(naphthalen-1-ylmethyl)pyrazol-4-yl]-3-(4-nitropyrazol-1-yl)propanamide Traditional Name: N-[1-(1-naphthylmethyl)pyrazol-4-yl]-3-(4-nitropyrazol-1-yl)propionamide Formula: C20H18N6O3 MolecularWeight: 390.39532

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CN3C=C(C=N3)NC(=O)CCN4C=C(C=N4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CN3C=C(C=N3)NC(=O)CCN4C=C(C=N4)[N+](=O)[O-]

InChI

InChI=1S/C20H18N6O3/c27-20(8-9-24-14-18(11-22-24)26(28)29)23-17-10-21-25(13-17)12-16-6-3-5-15-4-1-2-7-19(15)16/h1-7,10-11,13-14H,8-9,12H2,(H,23,27)