cyclohexylsulfamic acid; 2-diethylaminoethyl 9H-xanthene-9-carboxylate

Systemtic Name: cyclohexylsulfamic acid; 2-diethylaminoethyl 9H-xanthene-9-carboxylate Openeye Name: cyclohexylsulfamic acid; 2-diethylaminoethyl 9H-xanthene-9-carboxylate CAS Name: cyclohexylsulfamic acid; 9H-xanthene-9-carboxylic acid 2-diethylaminoethyl ester IUPAC Name: cyclohexylsulfamic acid; 2-diethylaminoethyl 9H-xanthene-9-carboxylate Traditional Name: cyclohexylsulfamic acid; 9H-xanthene-9-carboxylic acid 2-diethylaminoethyl ester Formula: C32H49N3O9S2 MolecularWeight: 683.87616

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=O)C1C2=CC=CC=C2OC3=CC=CC=C13.C1CCC(CC1)NS(=O)(=O)O.C1CCC(CC1)NS(=O)(=O)O

Isomeric SMILES

CCN(CC)CCOC(=O)C1C2=CC=CC=C2OC3=CC=CC=C13.C1CCC(CC1)NS(=O)(=O)O.C1CCC(CC1)NS(=O)(=O)O

InChI

InChI=1S/C20H23NO3.2C6H13NO3S/c1-3-21(4-2)13-14-23-20(22)19-15-9-5-7-11-17(15)24-18-12-8-6-10-16(18)19;2*8-11(9,10)7-6-4-2-1-3-5-6/h5-12,19H,3-4,13-14H2,1-2H3;2*6-7H,1-5H2,(H,8,9,10)