[5-(aziridin-1-yl)-2-cyclopropyl-1-methyl-4,7-bis(oxidanylidene)indol-3-yl]methyl carbamate

Systemtic Name: [5-(aziridin-1-yl)-2-cyclopropyl-1-methyl-4,7-bis(oxidanylidene)indol-3-yl]methyl carbamate Openeye Name: [5-(aziridin-1-yl)-2-cyclopropyl-1-methyl-4,7-dioxo-indol-3-yl]methyl carbamate CAS Name: carbamic acid [5-(1-aziridinyl)-2-cyclopropyl-1-methyl-4,7-dioxo-3-indolyl]methyl ester IUPAC Name: [5-(aziridin-1-yl)-2-cyclopropyl-1-methyl-4,7-dioxoindol-3-yl]methyl carbamate Traditional Name: carbamic acid (2-cyclopropyl-5-ethylenimino-4,7-diketo-1-methyl-indol-3-yl)methyl ester Formula: C16H17N3O4 MolecularWeight: 315.32388

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C2=C1C(=O)C=C(C2=O)N3CC3)COC(=O)N)C4CC4

Isomeric SMILES

CN1C(=C(C2=C1C(=O)C=C(C2=O)N3CC3)COC(=O)N)C4CC4

InChI

InChI=1S/C16H17N3O4/c1-18-13(8-2-3-8)9(7-23-16(17)22)12-14(18)11(20)6-10(15(12)21)19-4-5-19/h6,8H,2-5,7H2,1H3,(H2,17,22)