[3-butyl-4-[[3-[(4-nitrophenyl)methyl]imidazol-4-yl]methyl]piperazin-1-yl]-naphthalen-1-yl-methanone

Systemtic Name: [3-butyl-4-[[3-[(4-nitrophenyl)methyl]imidazol-4-yl]methyl]piperazin-1-yl]-naphthalen-1-yl-methanone Openeye Name: [3-butyl-4-[[3-[(4-nitrophenyl)methyl]imidazol-4-yl]methyl]piperazin-1-yl]-(1-naphthyl)methanone CAS Name: [3-butyl-4-[[3-[(4-nitrophenyl)methyl]-4-imidazolyl]methyl]-1-piperazinyl]-(1-naphthalenyl)methanone IUPAC Name: [3-butyl-4-[[3-[(4-nitrophenyl)methyl]imidazol-4-yl]methyl]piperazin-1-yl]-naphthalen-1-ylmethanone Traditional Name: [3-butyl-4-[[3-(4-nitrobenzyl)imidazol-4-yl]methyl]piperazino]-(1-naphthyl)methanone Formula: C30H33N5O3 MolecularWeight: 511.61472

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CN(CCN1CC2=CN=CN2CC3=CC=C(C=C3)[N+](=O)[O-])C(=O)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

CCCCC1CN(CCN1CC2=CN=CN2CC3=CC=C(C=C3)[N+](=O)[O-])C(=O)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C30H33N5O3/c1-2-3-9-26-20-33(30(36)29-11-6-8-24-7-4-5-10-28(24)29)17-16-32(26)21-27-18-31-22-34(27)19-23-12-14-25(15-13-23)35(37)38/h4-8,10-15,18,22,26H,2-3,9,16-17,19-21H2,1H3