sodium (Z)-[2-oxidanylidene-1-[3-(3-pentadecylphenyl)propyl]indol-3-ylidene]methanolate

Systemtic Name: sodium (Z)-[2-oxidanylidene-1-[3-(3-pentadecylphenyl)propyl]indol-3-ylidene]methanolate Openeye Name: sodium (Z)-[2-oxo-1-[3-(3-pentadecylphenyl)propyl]indolin-3-ylidene]methanolate CAS Name: sodium (Z)-[2-oxo-1-[3-(3-pentadecylphenyl)propyl]-3-indolylidene]methanolate IUPAC Name: sodium (Z)-[2-oxo-1-[3-(3-pentadecylphenyl)propyl]indol-3-ylidene]methanolate Traditional Name: sodium (Z)-[2-keto-1-[3-(3-pentadecylphenyl)propyl]indolin-3-ylidene]methanolate Formula: C33H46NNaO2 MolecularWeight: 511.71361

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC1=CC(=CC=C1)CCCN2C3=CC=CC=C3C(=C[O-])C2=O.[Na+]

Isomeric SMILES

CCCCCCCCCCCCCCCC1=CC(=CC=C1)CCCN2C3=CC=CC=C3/C(=C/[O-])/C2=O.[Na+]

InChI

InChI=1S/C33H47NO2.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-19-28-20-17-21-29(26-28)22-18-25-34-32-24-16-15-23-30(32)31(27-35)33(34)36;/h15-17,20-21,23-24,26-27,35H,2-14,18-19,22,25H2,1H3;/q;+1/p-1/b31-27-;