4-[4-[(2-methyl-2,3-dihydroindol-1-yl)carbonyl]phenyl]sulfonylpiperazine-1-carbaldehyde

Systemtic Name: 4-[4-[(2-methyl-2,3-dihydroindol-1-yl)carbonyl]phenyl]sulfonylpiperazine-1-carbaldehyde Openeye Name: 4-[4-(2-methylindoline-1-carbonyl)phenyl]sulfonylpiperazine-1-carbaldehyde CAS Name: 4-[4-[(2-methyl-2,3-dihydroindol-1-yl)-oxomethyl]phenyl]sulfonyl-1-piperazinecarboxaldehyde IUPAC Name: 4-[4-(2-methyl-2,3-dihydroindole-1-carbonyl)phenyl]sulfonylpiperazine-1-carbaldehyde Traditional Name: 4-[4-(2-methylindoline-1-carbonyl)phenyl]sulfonylpiperazine-1-carbaldehyde Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1C(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCN(CC4)C=O

Isomeric SMILES

CC1CC2=CC=CC=C2N1C(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCN(CC4)C=O

InChI

InChI=1S/C21H23N3O4S/c1-16-14-18-4-2-3-5-20(18)24(16)21(26)17-6-8-19(9-7-17)29(27,28)23-12-10-22(15-25)11-13-23/h2-9,15-16H,10-14H2,1H3