1-(3-azanylpropoxy)-6,6-dimethyl-3-pentyl-6a,7,10,10a-tetrahydrobenzo[c]chromene-9-carboxylic acid

Systemtic Name: 1-(3-azanylpropoxy)-6,6-dimethyl-3-pentyl-6a,7,10,10a-tetrahydrobenzo[c]chromene-9-carboxylic acid Openeye Name: 1-(3-aminopropoxy)-6,6-dimethyl-3-pentyl-6a,7,10,10a-tetrahydrobenzo[c]chromene-9-carboxylic acid CAS Name: 1-(3-aminopropoxy)-6,6-dimethyl-3-pentyl-6a,7,10,10a-tetrahydrobenzo[c][1]benzopyran-9-carboxylic acid IUPAC Name: 1-(3-aminopropoxy)-6,6-dimethyl-3-pentyl-6a,7,10,10a-tetrahydrobenzo[c]chromene-9-carboxylic acid Traditional Name: 1-(3-aminopropoxy)-3-amyl-6,6-dimethyl-6a,7,10,10a-tetrahydrobenzo[c]chromene-9-carboxylic acid Formula: C24H35NO4 MolecularWeight: 401.539

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC2=C(C3CC(=CCC3C(O2)(C)C)C(=O)O)C(=C1)OCCCN

Isomeric SMILES

CCCCCC1=CC2=C(C3CC(=CCC3C(O2)(C)C)C(=O)O)C(=C1)OCCCN

InChI

InChI=1S/C24H35NO4/c1-4-5-6-8-16-13-20(28-12-7-11-25)22-18-15-17(23(26)27)9-10-19(18)24(2,3)29-21(22)14-16/h9,13-14,18-19H,4-8,10-12,15,25H2,1-3H3,(H,26,27)