methyl 2-[[5-(1-benzofuran-7-yl)-3-methyl-1,2,4,5-tetrahydro-3-benzazepin-2-yl]oxycarbonylamino]-3-methyl-pentanoate

Systemtic Name: methyl 2-[[5-(1-benzofuran-7-yl)-3-methyl-1,2,4,5-tetrahydro-3-benzazepin-2-yl]oxycarbonylamino]-3-methyl-pentanoate Openeye Name: methyl 2-[[5-(benzofuran-7-yl)-3-methyl-1,2,4,5-tetrahydro-3-benzazepin-2-yl]oxycarbonylamino]-3-methyl-pentanoate CAS Name: 2-[[[5-(7-benzofuranyl)-3-methyl-1,2,4,5-tetrahydro-3-benzazepin-2-yl]oxy-oxomethyl]amino]-3-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[[5-(1-benzofuran-7-yl)-3-methyl-1,2,4,5-tetrahydro-3-benzazepin-2-yl]oxycarbonylamino]-3-methylpentanoate Traditional Name: 2-[[5-(benzofuran-7-yl)-3-methyl-1,2,4,5-tetrahydro-3-benzazepin-2-yl]oxycarbonylamino]-3-methyl-valeric acid methyl ester Formula: C27H32N2O5 MolecularWeight: 464.55338

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC)NC(=O)OC1CC2=CC=CC=C2C(CN1C)C3=CC=CC4=C3OC=C4

Isomeric SMILES

CCC(C)C(C(=O)OC)NC(=O)OC1CC2=CC=CC=C2C(CN1C)C3=CC=CC4=C3OC=C4

InChI

InChI=1S/C27H32N2O5/c1-5-17(2)24(26(30)32-4)28-27(31)34-23-15-19-9-6-7-11-20(19)22(16-29(23)3)21-12-8-10-18-13-14-33-25(18)21/h6-14,17,22-24H,5,15-16H2,1-4H3,(H,28,31)