[(E)-(5-methoxycyclohexa-2,4-dien-1-ylidene)amino] 2-dodecan-4-ylbenzenesulfonate

Systemtic Name: [(E)-(5-methoxycyclohexa-2,4-dien-1-ylidene)amino] 2-dodecan-4-ylbenzenesulfonate Openeye Name: [(E)-(5-methoxycyclohexa-2,4-dien-1-ylidene)amino] 2-(1-propylnonyl)benzenesulfonate CAS Name: 2-dodecan-4-ylbenzenesulfonic acid [(E)-(5-methoxy-1-cyclohexa-2,4-dienylidene)amino] ester IUPAC Name: [(E)-(5-methoxycyclohexa-2,4-dien-1-ylidene)amino] 2-dodecan-4-ylbenzenesulfonate Traditional Name: 2-(1-propylnonyl)benzenesulfonic acid [(E)-(5-methoxycyclohexa-2,4-dien-1-ylidene)amino] ester Formula: C25H37NO4S MolecularWeight: 447.63058

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(CCC)C1=CC=CC=C1S(=O)(=O)ON=C2CC(=CC=C2)OC

Isomeric SMILES

CCCCCCCCC(CCC)C1=CC=CC=C1S(=O)(=O)O/N=C/2\CC(=CC=C2)OC

InChI

InChI=1S/C25H37NO4S/c1-4-6-7-8-9-10-15-21(14-5-2)24-18-11-12-19-25(24)31(27,28)30-26-22-16-13-17-23(20-22)29-3/h11-13,16-19,21H,4-10,14-15,20H2,1-3H3/b26-22-