8-(1H-indol-3-ylmethyl)-2-(2-methylpropyl)-4-phenethyl-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione

Systemtic Name: 8-(1H-indol-3-ylmethyl)-2-(2-methylpropyl)-4-phenethyl-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione Openeye Name: 8-(1H-indol-3-ylmethyl)-2-isobutyl-4-phenethyl-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione CAS Name: 8-(1H-indol-3-ylmethyl)-2-(2-methylpropyl)-4-phenethyl-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione IUPAC Name: 8-(1H-indol-3-ylmethyl)-2-(2-methylpropyl)-4-phenethyl-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione Traditional Name: 8-(1H-indol-3-ylmethyl)-2-isobutyl-4-phenethyl-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-quinone Formula: C28H35N4O2+ MolecularWeight: 459.6031

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2(CC[NH+](CC2)CC3=CNC4=CC=CC=C43)N(C1=O)CCC5=CC=CC=C5

Isomeric SMILES

CC(C)CN1C(=O)C2(CC[NH+](CC2)CC3=CNC4=CC=CC=C43)N(C1=O)CCC5=CC=CC=C5

InChI

InChI=1S/C28H34N4O2/c1-21(2)19-31-26(33)28(32(27(31)34)15-12-22-8-4-3-5-9-22)13-16-30(17-14-28)20-23-18-29-25-11-7-6-10-24(23)25/h3-11,18,21,29H,12-17,19-20H2,1-2H3/p+1