diethyl-[[1-[4-(3-nitrophenyl)carbonyloxyphenyl]indol-2-yl]carbonyl-propyl-amino]-oxidanyl-azanium

Systemtic Name: diethyl-[[1-[4-(3-nitrophenyl)carbonyloxyphenyl]indol-2-yl]carbonyl-propyl-amino]-oxidanyl-azanium Openeye Name: diethyl-hydroxy-[[1-[4-(3-nitrobenzoyl)oxyphenyl]indole-2-carbonyl]-propyl-amino]ammonium CAS Name: diethyl-hydroxy-[[[1-[4-[(3-nitrophenyl)-oxomethoxy]phenyl]-2-indolyl]-oxomethyl]-propylamino]ammonium IUPAC Name: diethyl-hydroxy-[[1-[4-(3-nitrobenzoyl)oxyphenyl]indole-2-carbonyl]-propylamino]azanium Traditional Name: diethyl-hydroxy-[[1-[4-(3-nitrobenzoyl)oxyphenyl]indole-2-carbonyl]-propyl-amino]ammonium Formula: C29H31N4O6+ MolecularWeight: 531.57964

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C(=O)C1=CC2=CC=CC=C2N1C3=CC=C(C=C3)OC(=O)C4=CC(=CC=C4)[N+](=O)[O-])[N+](CC)(CC)O

Isomeric SMILES

CCCN(C(=O)C1=CC2=CC=CC=C2N1C3=CC=C(C=C3)OC(=O)C4=CC(=CC=C4)[N+](=O)[O-])[N+](CC)(CC)O

InChI

InChI=1S/C29H31N4O6/c1-4-18-30(33(38,5-2)6-3)28(34)27-20-21-10-7-8-13-26(21)31(27)23-14-16-25(17-15-23)39-29(35)22-11-9-12-24(19-22)32(36)37/h7-17,19-20,38H,4-6,18H2,1-3H3/q+1