sodium; hydrogen sulfate; 1-methyl-9-[(E)-2-phenylethenyl]pyrido[3,4-b]indole-3-carbaldehyde

Systemtic Name: sodium; hydrogen sulfate; 1-methyl-9-[(E)-2-phenylethenyl]pyrido[3,4-b]indole-3-carbaldehyde Openeye Name: sodium; hydrogen sulfate; 1-methyl-9-[(E)-styryl]pyrido[3,4-b]indole-3-carbaldehyde CAS Name: sodium; hydrogen sulfate; 1-methyl-9-[(E)-2-phenylethenyl]-3-pyrido[3,4-b]indolecarboxaldehyde IUPAC Name: sodium; hydrogen sulfate; 1-methyl-9-[(E)-2-phenylethenyl]pyrido[3,4-b]indole-3-carbaldehyde Traditional Name: sodium 1-methyl-9-[(E)-styryl]-$b-carboline-3-carbaldehyde bisulfate Formula: C21H17N2NaO5S MolecularWeight: 432.42485

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=N1)C=O)C3=CC=CC=C3N2C=CC4=CC=CC=C4.OS(=O)(=O)[O-].[Na+]

Isomeric SMILES

CC1=C2C(=CC(=N1)C=O)C3=CC=CC=C3N2/C=C/C4=CC=CC=C4.OS(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C21H16N2O.Na.H2O4S/c1-15-21-19(13-17(14-24)22-15)18-9-5-6-10-20(18)23(21)12-11-16-7-3-2-4-8-16;;1-5(2,3)4/h2-14H,1H3;;(H2,1,2,3,4)/q;+1;/p-1/b12-11+;;