methyl 1-(3,6-ditert-butyl-2-methoxy-naphthalen-1-yl)isoquinoline-3-carboxylate

Systemtic Name: methyl 1-(3,6-ditert-butyl-2-methoxy-naphthalen-1-yl)isoquinoline-3-carboxylate Openeye Name: methyl 1-(3,6-ditert-butyl-2-methoxy-1-naphthyl)isoquinoline-3-carboxylate CAS Name: 1-(3,6-ditert-butyl-2-methoxy-1-naphthalenyl)-3-isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 1-(3,6-ditert-butyl-2-methoxynaphthalen-1-yl)isoquinoline-3-carboxylate Traditional Name: 1-(3,6-ditert-butyl-2-methoxy-1-naphthyl)isoquinoline-3-carboxylic acid methyl ester Formula: C30H33NO3 MolecularWeight: 455.58792

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=CC(=C(C(=C2C=C1)C3=NC(=CC4=CC=CC=C43)C(=O)OC)OC)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC2=CC(=C(C(=C2C=C1)C3=NC(=CC4=CC=CC=C43)C(=O)OC)OC)C(C)(C)C

InChI

InChI=1S/C30H33NO3/c1-29(2,3)20-13-14-21-19(15-20)16-23(30(4,5)6)27(33-7)25(21)26-22-12-10-9-11-18(22)17-24(31-26)28(32)34-8/h9-17H,1-8H3