methyl 4-methylbenzoate; 5-phenylmethoxy-N-(4-propan-2-ylphenyl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide

Systemtic Name: methyl 4-methylbenzoate; 5-phenylmethoxy-N-(4-propan-2-ylphenyl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide Openeye Name: 5-benzyloxy-N-(4-isopropylphenyl)tetralin-1-carboxamide; methyl 4-methylbenzoate CAS Name: 4-methylbenzoic acid methyl ester; 5-phenylmethoxy-N-(4-propan-2-ylphenyl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide IUPAC Name: methyl 4-methylbenzoate; 5-phenylmethoxy-N-(4-propan-2-ylphenyl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide Traditional Name: 5-benzoxy-N-p-cumenyl-tetralin-1-carboxamide; 4-methylbenzoic acid methyl ester Formula: C36H39NO4 MolecularWeight: 549.69916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC.CC(C)C1=CC=C(C=C1)NC(=O)C2CCCC3=C2C=CC=C3OCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC.CC(C)C1=CC=C(C=C1)NC(=O)C2CCCC3=C2C=CC=C3OCC4=CC=CC=C4

InChI

InChI=1S/C27H29NO2.C9H10O2/c1-19(2)21-14-16-22(17-15-21)28-27(29)25-12-6-11-24-23(25)10-7-13-26(24)30-18-20-8-4-3-5-9-20;1-7-3-5-8(6-4-7)9(10)11-2/h3-5,7-10,13-17,19,25H,6,11-12,18H2,1-2H3,(H,28,29);3-6H,1-2H3