[1-[[1-(7-azanyl-3,4-dihydro-1H-isoquinolin-2-yl)-1-oxidanylidene-3-phenylmethoxy-propan-2-yl]amino]-2-methyl-1-oxidanylidene-propan-2-yl]carbamic acid

Systemtic Name: [1-[[1-(7-azanyl-3,4-dihydro-1H-isoquinolin-2-yl)-1-oxidanylidene-3-phenylmethoxy-propan-2-yl]amino]-2-methyl-1-oxidanylidene-propan-2-yl]carbamic acid Openeye Name: [2-[[2-(7-amino-3,4-dihydro-1H-isoquinolin-2-yl)-1-(benzyloxymethyl)-2-oxo-ethyl]amino]-1,1-dimethyl-2-oxo-ethyl]carbamic acid CAS Name: [1-[[1-(7-amino-3,4-dihydro-1H-isoquinolin-2-yl)-1-oxo-3-phenylmethoxypropan-2-yl]amino]-2-methyl-1-oxopropan-2-yl]carbamic acid IUPAC Name: [1-[[1-(7-amino-3,4-dihydro-1H-isoquinolin-2-yl)-1-oxo-3-phenylmethoxypropan-2-yl]amino]-2-methyl-1-oxopropan-2-yl]carbamic acid Traditional Name: [2-[[2-(7-amino-3,4-dihydro-1H-isoquinolin-2-yl)-1-(benzoxymethyl)-2-keto-ethyl]amino]-2-keto-1,1-dimethyl-ethyl]carbamic acid Formula: C24H30N4O5 MolecularWeight: 454.5188

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)NC(COCC1=CC=CC=C1)C(=O)N2CCC3=C(C2)C=C(C=C3)N)NC(=O)O

Isomeric SMILES

CC(C)(C(=O)NC(COCC1=CC=CC=C1)C(=O)N2CCC3=C(C2)C=C(C=C3)N)NC(=O)O

InChI

InChI=1S/C24H30N4O5/c1-24(2,27-23(31)32)22(30)26-20(15-33-14-16-6-4-3-5-7-16)21(29)28-11-10-17-8-9-19(25)12-18(17)13-28/h3-9,12,20,27H,10-11,13-15,25H2,1-2H3,(H,26,30)(H,31,32)