[2-(dipentylamino)-1-(1,2,3,4-tetrahydrophenanthren-9-yl)ethyl] ethanoate

Systemtic Name: [2-(dipentylamino)-1-(1,2,3,4-tetrahydrophenanthren-9-yl)ethyl] ethanoate Openeye Name: [2-(dipentylamino)-1-(1,2,3,4-tetrahydrophenanthren-9-yl)ethyl] acetate CAS Name: acetic acid [2-(dipentylamino)-1-(1,2,3,4-tetrahydrophenanthren-9-yl)ethyl] ester IUPAC Name: [2-(dipentylamino)-1-(1,2,3,4-tetrahydrophenanthren-9-yl)ethyl] acetate Traditional Name: acetic acid [2-(diamylamino)-1-(1,2,3,4-tetrahydrophenanthren-9-yl)ethyl] ester Formula: C28H41NO2 MolecularWeight: 423.63064

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CCCCC)CC(C1=CC2=C(CCCC2)C3=CC=CC=C31)OC(=O)C

Isomeric SMILES

CCCCCN(CCCCC)CC(C1=CC2=C(CCCC2)C3=CC=CC=C31)OC(=O)C

InChI

InChI=1S/C28H41NO2/c1-4-6-12-18-29(19-13-7-5-2)21-28(31-22(3)30)27-20-23-14-8-9-15-24(23)25-16-10-11-17-26(25)27/h10-11,16-17,20,28H,4-9,12-15,18-19,21H2,1-3H3