3-[(3-cyclopentyloxy-4-methoxy-phenyl)-(quinolin-2-ylmethyl)amino]-2-methyl-cyclopent-2-en-1-one

Systemtic Name: 3-[(3-cyclopentyloxy-4-methoxy-phenyl)-(quinolin-2-ylmethyl)amino]-2-methyl-cyclopent-2-en-1-one Openeye Name: 3-[3-(cyclopentoxy)-4-methoxy-N-(2-quinolylmethyl)anilino]-2-methyl-cyclopent-2-en-1-one CAS Name: 3-[3-cyclopentyloxy-4-methoxy-N-(2-quinolinylmethyl)anilino]-2-methyl-1-cyclopent-2-enone IUPAC Name: 3-[3-cyclopentyloxy-4-methoxy-N-(quinolin-2-ylmethyl)anilino]-2-methylcyclopent-2-en-1-one Traditional Name: 3-[3-(cyclopentoxy)-4-methoxy-N-(2-quinolylmethyl)anilino]-2-methyl-cyclopent-2-en-1-one Formula: C28H30N2O3 MolecularWeight: 442.5494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CCC1=O)N(CC2=NC3=CC=CC=C3C=C2)C4=CC(=C(C=C4)OC)OC5CCCC5

Isomeric SMILES

CC1=C(CCC1=O)N(CC2=NC3=CC=CC=C3C=C2)C4=CC(=C(C=C4)OC)OC5CCCC5

InChI

InChI=1S/C28H30N2O3/c1-19-25(14-15-26(19)31)30(18-21-12-11-20-7-3-6-10-24(20)29-21)22-13-16-27(32-2)28(17-22)33-23-8-4-5-9-23/h3,6-7,10-13,16-17,23H,4-5,8-9,14-15,18H2,1-2H3