3-butyl-3-ethyl-5-(3-methoxyphenyl)-4-oxidanyl-1,1-bis(oxidanylidene)-4,5-dihydro-2H-1$l^{6}-benzothiepine-7-carbaldehyde

Systemtic Name: 3-butyl-3-ethyl-5-(3-methoxyphenyl)-4-oxidanyl-1,1-bis(oxidanylidene)-4,5-dihydro-2H-1$l^{6}-benzothiepine-7-carbaldehyde Openeye Name: 3-butyl-3-ethyl-4-hydroxy-5-(3-methoxyphenyl)-1,1-dioxo-4,5-dihydro-2H-1$l^{6}-benzothiepine-7-carbaldehyde CAS Name: 3-butyl-3-ethyl-4-hydroxy-5-(3-methoxyphenyl)-1,1-dioxo-4,5-dihydro-2H-1$l^{6}-benzothiepin-7-carboxaldehyde IUPAC Name: 3-butyl-3-ethyl-4-hydroxy-5-(3-methoxyphenyl)-1,1-dioxo-4,5-dihydro-2H-1$l^{6}-benzothiepine-7-carbaldehyde Traditional Name: 3-butyl-3-ethyl-4-hydroxy-1,1-diketo-5-(3-methoxyphenyl)-4,5-dihydro-2H-1$l^{6}-benzothiepin-7-carbaldehyde Formula: C24H30O5S MolecularWeight: 430.557

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(CS(=O)(=O)C2=C(C=C(C=C2)C=O)C(C1O)C3=CC(=CC=C3)OC)CC

Isomeric SMILES

CCCCC1(CS(=O)(=O)C2=C(C=C(C=C2)C=O)C(C1O)C3=CC(=CC=C3)OC)CC

InChI

InChI=1S/C24H30O5S/c1-4-6-12-24(5-2)16-30(27,28)21-11-10-17(15-25)13-20(21)22(23(24)26)18-8-7-9-19(14-18)29-3/h7-11,13-15,22-23,26H,4-6,12,16H2,1-3H3