[4-(4-aminocarbonylphenyl)-3-methyl-phenyl]carbonyl-diethyl-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]azanium

Systemtic Name: [4-(4-aminocarbonylphenyl)-3-methyl-phenyl]carbonyl-diethyl-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]azanium Openeye Name: [4-(4-carbamoylphenyl)-3-methyl-benzoyl]-diethyl-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]ammonium CAS Name: [[4-(4-carbamoylphenyl)-3-methylphenyl]-oxomethyl]-diethyl-[4-methoxy-3-(4-methyl-1-piperazinyl)phenyl]ammonium IUPAC Name: [4-(4-carbamoylphenyl)-3-methylbenzoyl]-diethyl-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]azanium Traditional Name: [4-(4-carbamoylphenyl)-3-methyl-benzoyl]-diethyl-[4-methoxy-3-(4-methylpiperazino)phenyl]ammonium Formula: C31H39N4O3+ MolecularWeight: 515.66636

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](CC)(C1=CC(=C(C=C1)OC)N2CCN(CC2)C)C(=O)C3=CC(=C(C=C3)C4=CC=C(C=C4)C(=O)N)C

Isomeric SMILES

CC[N+](CC)(C1=CC(=C(C=C1)OC)N2CCN(CC2)C)C(=O)C3=CC(=C(C=C3)C4=CC=C(C=C4)C(=O)N)C

InChI

InChI=1S/C31H38N4O3/c1-6-35(7-2,26-13-15-29(38-5)28(21-26)34-18-16-33(4)17-19-34)31(37)25-12-14-27(22(3)20-25)23-8-10-24(11-9-23)30(32)36/h8-15,20-21H,6-7,16-19H2,1-5H3,(H-,32,36)/p+1