(2S,4E,7R)-7,11-dimethyl-1-phenylmethoxy-2-[(triphenylmethyl)amino]dodeca-4,10-dien-3-one

Systemtic Name: (2S,4E,7R)-7,11-dimethyl-1-phenylmethoxy-2-[(triphenylmethyl)amino]dodeca-4,10-dien-3-one Openeye Name: (2S,4E,7R)-1-benzyloxy-7,11-dimethyl-2-(tritylamino)dodeca-4,10-dien-3-one CAS Name: (2S,4E,7R)-7,11-dimethyl-1-phenylmethoxy-2-[(triphenylmethyl)amino]-3-dodeca-4,10-dienone IUPAC Name: (2S,4E,7R)-7,11-dimethyl-1-phenylmethoxy-2-(tritylamino)dodeca-4,10-dien-3-one Traditional Name: (2S,4E,7R)-1-benzoxy-7,11-dimethyl-2-(tritylamino)dodeca-4,10-dien-3-one Formula: C40H45NO2 MolecularWeight: 571.7908

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC=C(C)C)CC=CC(=O)C(COCC1=CC=CC=C1)NC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C[C@H](CCC=C(C)C)C/C=C/C(=O)[C@H](COCC1=CC=CC=C1)NC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C40H45NO2/c1-32(2)18-16-19-33(3)20-17-29-39(42)38(31-43-30-34-21-8-4-9-22-34)41-40(35-23-10-5-11-24-35,36-25-12-6-13-26-36)37-27-14-7-15-28-37/h4-15,17-18,21-29,33,38,41H,16,19-20,30-31H2,1-3H3/b29-17+/t33-,38+/m1/s1