[3-(1-methylindol-2-yl)-1-oxidanyl-1-oxidanylidene-propan-2-yl]-[(E)-octadec-9-enyl]-oxidanylidene-azanium

Systemtic Name: [3-(1-methylindol-2-yl)-1-oxidanyl-1-oxidanylidene-propan-2-yl]-[(E)-octadec-9-enyl]-oxidanylidene-azanium Openeye Name: [2-hydroxy-1-[(1-methylindol-2-yl)methyl]-2-oxo-ethyl]-[(E)-octadec-9-enyl]-oxo-ammonium CAS Name: [1-hydroxy-3-(1-methyl-2-indolyl)-1-oxopropan-2-yl]-[(E)-octadec-9-enyl]-oxoammonium IUPAC Name: [1-hydroxy-3-(1-methylindol-2-yl)-1-oxopropan-2-yl]-[(E)-octadec-9-enyl]-oxoazanium Traditional Name: [2-hydroxy-2-keto-1-[(1-methylindol-2-yl)methyl]ethyl]-keto-[(E)-octadec-9-enyl]ammonium Formula: C30H47N2O3+ MolecularWeight: 483.70578

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC[N+](=O)C(CC1=CC2=CC=CC=C2N1C)C(=O)O

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC[N+](=O)C(CC1=CC2=CC=CC=C2N1C)C(=O)O

InChI

InChI=1S/C30H46N2O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-23-32(35)29(30(33)34)25-27-24-26-21-18-19-22-28(26)31(27)2/h10-11,18-19,21-22,24,29H,3-9,12-17,20,23,25H2,1-2H3/p+1/b11-10+