[[1-(tert-butylamino)-2-methyl-1-oxidanylidene-hex-5-en-2-yl]-(phenylmethyl)amino] 2-phenylethanoate

Systemtic Name: [[1-(tert-butylamino)-2-methyl-1-oxidanylidene-hex-5-en-2-yl]-(phenylmethyl)amino] 2-phenylethanoate Openeye Name: [benzyl-[1-(tert-butylcarbamoyl)-1-methyl-pent-4-enyl]amino] 2-phenylacetate CAS Name: 2-phenylacetic acid [[1-(tert-butylamino)-2-methyl-1-oxohex-5-en-2-yl]-(phenylmethyl)amino] ester IUPAC Name: [benzyl-[1-(tert-butylamino)-2-methyl-1-oxohex-5-en-2-yl]amino] 2-phenylacetate Traditional Name: 2-phenylacetic acid [benzyl-[1-(tert-butylcarbamoyl)-1-methyl-pent-4-enyl]amino] ester Formula: C26H34N2O3 MolecularWeight: 422.55976

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C(C)(CCC=C)N(CC1=CC=CC=C1)OC(=O)CC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)NC(=O)C(C)(CCC=C)N(CC1=CC=CC=C1)OC(=O)CC2=CC=CC=C2

InChI

InChI=1S/C26H34N2O3/c1-6-7-18-26(5,24(30)27-25(2,3)4)28(20-22-16-12-9-13-17-22)31-23(29)19-21-14-10-8-11-15-21/h6,8-17H,1,7,18-20H2,2-5H3,(H,27,30)