[(4-heptylpiperazin-1-yl)-phenyl-methyl] (1S,2S)-2-methoxy-1-(4-methoxyphenyl)cyclopropane-1-carboxylate

Systemtic Name: [(4-heptylpiperazin-1-yl)-phenyl-methyl] (1S,2S)-2-methoxy-1-(4-methoxyphenyl)cyclopropane-1-carboxylate Openeye Name: [(4-heptylpiperazin-1-yl)-phenyl-methyl] (1S,2S)-2-methoxy-1-(4-methoxyphenyl)cyclopropanecarboxylate CAS Name: (1S,2S)-2-methoxy-1-(4-methoxyphenyl)-1-cyclopropanecarboxylic acid [(4-heptyl-1-piperazinyl)-phenylmethyl] ester IUPAC Name: [(4-heptylpiperazin-1-yl)-phenylmethyl] (1S,2S)-2-methoxy-1-(4-methoxyphenyl)cyclopropane-1-carboxylate Traditional Name: (1S,2S)-2-methoxy-1-(4-methoxyphenyl)cyclopropanecarboxylic acid [(4-heptylpiperazino)-phenyl-methyl] ester Formula: C30H42N2O4 MolecularWeight: 494.66548

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1CCN(CC1)C(C2=CC=CC=C2)OC(=O)C3(CC3OC)C4=CC=C(C=C4)OC

Isomeric SMILES

CCCCCCCN1CCN(CC1)C(C2=CC=CC=C2)OC(=O)[C@@]3(C[C@@H]3OC)C4=CC=C(C=C4)OC

InChI

InChI=1S/C30H42N2O4/c1-4-5-6-7-11-18-31-19-21-32(22-20-31)28(24-12-9-8-10-13-24)36-29(33)30(23-27(30)35-3)25-14-16-26(34-2)17-15-25/h8-10,12-17,27-28H,4-7,11,18-23H2,1-3H3/t27-,28?,30-/m0/s1