3-(3-isocyanato-5-methyl-indol-1-yl)propylcarbamic acid

Systemtic Name: 3-(3-isocyanato-5-methyl-indol-1-yl)propylcarbamic acid Openeye Name: 3-(3-isocyanato-5-methyl-indol-1-yl)propylcarbamic acid CAS Name: 3-(3-isocyanato-5-methyl-1-indolyl)propylcarbamic acid IUPAC Name: 3-(3-isocyanato-5-methylindol-1-yl)propylcarbamic acid Traditional Name: 3-(3-isocyanato-5-methyl-indol-1-yl)propylcarbamic acid Formula: C14H15N3O3 MolecularWeight: 273.2872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C=C2N=C=O)CCCNC(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1)N(C=C2N=C=O)CCCNC(=O)O

InChI

InChI=1S/C14H15N3O3/c1-10-3-4-13-11(7-10)12(16-9-18)8-17(13)6-2-5-15-14(19)20/h3-4,7-8,15H,2,5-6H2,1H3,(H,19,20)